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Information card for entry 1551780
Preview
| Coordinates | 1551780.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H32 N10 O16 |
|---|---|
| Calculated formula | C32 H32 N10 O16 |
| Title of publication | Synthesis and Crystal Structure of 1,1′-Butane-1,4-diyl-dibenzimidazolium Picrate |
| Authors of publication | YAN, Zhen-Zhong; HOU, Na; LIANG, Hua-Ding; ZHAO, Song-Lin; TANG, Yu |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2009 |
| Journal volume | 25 |
| Pages of publication | 31 |
| a | 6.9285 ± 0.0006 Å |
| b | 10.8287 ± 0.0009 Å |
| c | 12.9941 ± 0.0011 Å |
| α | 100 ± 0.004° |
| β | 104.942 ± 0.003° |
| γ | 94.865 ± 0.004° |
| Cell volume | 918.99 ± 0.14 Å3 |
| Cell temperature | 294 ± 2 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0861 |
| Residual factor for significantly intense reflections | 0.064 |
| Weighted residual factors for significantly intense reflections | 0.1709 |
| Weighted residual factors for all reflections included in the refinement | 0.1932 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216392 (current) | 2019-06-20 | cif/ Adding structures of 1551780 via cif-deposit CGI script. |
1551780.cif |
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Users of the data should acknowledge the original authors of the
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